N-butyl-4-chloranyl-N-ethyl-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-butyl-4-chloranyl-N-ethyl-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-butyl-4-chloro-N-ethyl-3-methyl-1-(p-tolyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-butyl-4-chloro-N-ethyl-3-methyl-1-(4-methylphenyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-butyl-4-chloro-N-ethyl-3-methyl-1-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-butyl-4-chloro-N-ethyl-3-methyl-1-(p-tolyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H25ClN4O MolecularWeight: 384.9024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)C1=CN=C2C(=C1Cl)C(=NN2C3=CC=C(C=C3)C)C

Isomeric SMILES

CCCCN(CC)C(=O)C1=CN=C2C(=C1Cl)C(=NN2C3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H25ClN4O/c1-5-7-12-25(6-2)21(27)17-13-23-20-18(19(17)22)15(4)24-26(20)16-10-8-14(3)9-11-16/h8-11,13H,5-7,12H2,1-4H3